Vitas-M small molecule compound

methyl 2-[({2-[4-(2,4-dichlorophenoxy)butanoyl]hydrazinyl}carbonothioyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate

Catalog ID
STK455647
SMILES COC(=O)c1c(NC(=S)NNC(=O)CCCOc2ccc(cc2Cl)Cl)sc2c1CCC2

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C20H21Cl2N3O4S2 MW 502.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21Cl2N3O4S2/c1-28-19(27)17-12-4-2-5-15(12)31-18(17)23-20(30)25-24-16(26)6-3-9-29-14-8-7-11(21)10-13(14)22/h7-8,10H,2-6,9H2,1H3,(H,24,26)(H2,23,25,30)
InChIKey
AJWLBHQWYZVBBI-UHFFFAOYSA-N
Synonyms

COC(=O)C1=C(SC2=C1CCC2)NC(=S)NNC(=O)CCCOC3=C(C=C(C=C3)Cl)Cl
InChI=1SC20H21Cl2N3O4S2c12819(27)171242515(12)3118(17)2320(30)252416(26)63929148711(21)1013(14)22h7810H269H21H3(H2426)(H2232530)
METHYL2((((4(24DICHLOROPHENOXY)BUTANOYLAMINO)AMINO)THIOXOMETHYL)AMINO)456TRIHYDROCYCLOPENTA(21B)THIOPHENE3CARBOXYLATE
methyl2(((2(4(24dichlorophenoxy)butanoyl)hydrazinyl)carbonothioyl)amino)56dihydro4Hcyclopenta(b)thiophene3carboxylate
METHYL2((4(24DICHLOROPHENOXY)BUTANOYLAMINO)CARBAMOTHIOYLAMINO)56DIHYDRO4HCYCLOPENTA(B)THIOPHENE3CARBOXYLATE
MFCD04227502
ZINC000016345645
ZINC16345645

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Available files

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